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CUDA-Programming
Sample codes for my CUDA programming bookGPUMD
Graphics Processing Units Molecular DynamicsMolecular-Dynamics-Simulation
Sample codes for my book on molecular dynamics simulationNEP_CPU
CPU version of NEPgpuqt
A CUDA-implementation of linear-scaling quantum transport methodsAGF-phonon-transport
A 200-line Matlab implementation of the Atomistic Green's function (AGF) method for phonon transportGPUGA
Graphics Processing Units Genetic AlgorithmLSQT-Jupyter
A tutorial on the linear scaling quantum transport methods using Jupyter (with Python3)solid-state-physics
Sample codes on computational solid state physicsNEGF-phonon-1D-matlab
A 100-line Matlab code for phonon transport in 1D atomic chain using the NEGF methodVASP-post-processing
Some codes/scripts I wrote for post-processing the ugly formatted VASP outputs.MATLADY
A MATlab toolkit for LAttice DYnamics calculations based on empirical potentialsdynamical-matrix-matlab
A 200-line MATLAB code for calculating the dynamical matrix using the Tersoff potentiallsqt-matlab
A 200-line MATLAB code for a linear-scaling quantum transport methodsimple-ga-matlab
A 50-line Matlab implementation of a simple genetic algorithmRGF-electron-matlab
A 100-line MATLAB code for the recursive Green's function method for electron transportLove Open Source and this site? Check out how you can help us